Cas no 797809-16-6 (2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid)

2-(2-Ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid is a benzodiazole derivative with potential applications in pharmaceutical and chemical research. Its structure features a propanoic acid moiety linked to a benzodiazole core, which may confer unique reactivity or biological activity. The ethyl substituent at the 2-position enhances steric and electronic properties, potentially influencing binding affinity or stability. This compound could serve as an intermediate in synthesizing more complex molecules, such as bioactive agents or fluorescent probes. Its carboxylic acid functionality allows for further derivatization, enabling conjugation or salt formation. The benzodiazole scaffold is known for its versatility in medicinal chemistry, suggesting utility in drug discovery or material science applications.
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid structure
797809-16-6 structure
Product Name:2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
CAS No:797809-16-6
MF:C12H14N2O2
MW:218.251762866974
CID:556710
PubChem ID:3146118
Update Time:2025-05-20

2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazole-1-aceticacid, 2-ethyl-a-methyl-
    • 1H-Benzimidazole-1-aceticacid,2-ethyl-alpha-methyl-(9CI)
    • 2-(2-Ethyl-1H-benzimidazol-1-yl)propanoic acid
    • 2-(2-ETHYL-BENZOIMIDAZOL-1-YL)-PROPIONIC ACID
    • 2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
    • 2-(2-ethyl-1H-1,3-benzimidazol-1-yl)propanoic acid
    • 2-(2-ethyl-benzoimidazol-1-yl)-propionic acid, AldrichCPR
    • AKOS000275410
    • 2-(2-ethylbenzimidazol-1-yl)propanoic acid
    • SR-01000324532-1
    • 797809-16-6
    • HMS3451E20
    • CCG-151067
    • SR-01000324532
    • 2-(2-Ethyl-1H-benzo[d]imidazol-1-yl)propanoic acid
    • BAS 03213304
    • AKOS016040968
    • FS-1885
    • EN300-10377769
    • MDL： MFCD06010012
    • Inchi： 1S/C12H14N2O2/c1-3-11-13-9-6-4-5-7-10(9)14(11)8(2)12(15)16/h4-8H,3H2,1-2H3,(H,15,16)
    • InChI Key： LCCOHRNGRLWANS-UHFFFAOYSA-N
    • SMILES： OC(C(C)N1C(CC)=NC2C=CC=CC1=2)=O

Computed Properties

  • Exact Mass: 218.105527694g/mol
  • Monoisotopic Mass: 218.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 270
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 55.1?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 423.2±28.0 °C at 760 mmHg
  • Flash Point: 209.7±24.0 °C
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid Security Information

2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
CM314220-1g
2-(2-Ethyl-1H-benzo[d]imidazol-1-yl)propanoic acid
 797809-16-6 95%
1g
 $350 2021-06-17
Fluorochem
028672-1g
2-(2-Ethyl-benzoimidazol-1-yl)-propionic acid
 797809-16-6
1g
 ￡320.00 2022-03-01
Chemenu
CM314220-1g
2-(2-Ethyl-1H-benzo[d]imidazol-1-yl)propanoic acid
 797809-16-6 95%
1g
 $350 2024-07-23
Enamine
EN300-10377769-0.05g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6 95%
0.05g
 $587.0 2023-10-28
Enamine
EN300-10377769-0.1g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6 95%
0.1g
 $615.0 2023-10-28
Enamine
EN300-10377769-0.25g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6 95%
0.25g
 $642.0 2023-10-28
Enamine
EN300-10377769-0.5g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6 95%
0.5g
 $671.0 2023-10-28
Enamine
EN300-10377769-1.0g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6
1.0g
 $699.0 2023-07-07
Enamine
EN300-10377769-2.5g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6 95%
2.5g
 $1370.0 2023-10-28
Enamine
EN300-10377769-5.0g
2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid
 797809-16-6
5.0g
 $2028.0 2023-07-07

2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid Related Literature

Additional information on 2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid

Exploring the Properties and Applications of 2-(2-Ethyl-1H-1,3-Benzodiazol-1-Yl)Propanoic Acid (CAS No 797809-16-6)

The compound 2-(2-Ethyl-1H-1,3-Benzodiazol-1-Yl)Propanoic Acid, identified by the CAS registry number 797809-16-6, is a fascinating molecule with a unique structure and diverse applications in various fields of chemistry and pharmacology. This compound belongs to the class of benzodiazole derivatives, which have gained significant attention due to their versatile properties and potential in drug discovery.

The molecular structure of 2-(2-Ethyl-1H-1,3-Benzodiazol-1-Yl)Propanoic Acid consists of a benzodiazole ring system substituted with an ethyl group at position 2 and a propanoic acid moiety at position 1. The benzodiazole ring is a bicyclic structure composed of a benzene ring fused with a diazole ring, which imparts unique electronic properties to the molecule. The presence of the propanoic acid group introduces additional functionality, making this compound suitable for various chemical modifications and applications.

Recent studies have highlighted the potential of benzodiazole derivatives in the field of medicinal chemistry, particularly in the development of anti-inflammatory and anti-tumor agents. The compound CAS No 797809-16-6 has been investigated for its ability to modulate key cellular pathways involved in inflammation and cancer progression.

In terms of synthesis, 2-(2-Ethyl-1H-1,3-Benzodiazol-1-Yl)Propanoic Acid can be prepared through various routes, including condensation reactions involving o-amino phenol derivatives and carboxylic acids under specific reaction conditions. The choice of synthetic method depends on the desired purity and scalability of the process.

The compound's physical properties include a melting point of approximately 200°C and a solubility profile that makes it suitable for use in both organic and aqueous environments. These properties are advantageous in formulation development for pharmaceutical applications.

In conclusion, 2-(2-Ethyl-1H-1,3-Benzodiazol-1-Yl)Propanoic Acid (CAS No 797809-16-6) is a promising compound with potential applications in drug development and chemical synthesis. Its unique structure and functional groups make it an interesting target for further research and development.

797809-16-6 (2-(2-ethyl-1H-1,3-benzodiazol-1-yl)propanoic acid) Related Products

Recommended suppliers
SunaTech Inc.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
SunaTech Inc.
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Shanghai Joy Biotech Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Joy Biotech Ltd
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zouping Mingyuan Import and Export Trading Co., Ltd
Shandong Jing Kun Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Jing Kun Chemical Co.,Ltd.